SCHEMBL7144050

SCHEMBL7144050

CC(C)CCCCCOC(=O)CCc1cc(-n2nc3cccc(C(F)(F)F)c3n2)c(O)c(C(C)(C)C)c1

nearest known ligand 0.31

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE1A P54750 1/20 0.31
PDE1B Q01064 1/20 0.31
PDE1C Q14123 1/20 0.31
ALOX5 P09917 1/20 0.31
GAA P10253 2/20 0.30
MEN1 O00255 2/20 0.30
KMT2A Q03164 2/20 0.30
MAOA P21397 1/20 0.30
MAOB P27338 1/20 0.30
P2RY10 O00398 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL141324 0.90 ALOX5 (0.37) PDE1APDE1BPDE1CALOX5GAA
SCHEMBL9221981 0.90 ALOX5 (0.37) PDE1APDE1BPDE1CALOX5GAA
SCHEMBL2641197 0.87 MC4R (0.32) GAAMEN1KMT2A
SCHEMBL5693435 0.84 GAA (0.40) GAAMEN1KMT2AMAOAMAOB
SCHEMBL672759 0.84 ALOX5 (0.41) ALOX5GAAMEN1KMT2AMAOA
SCHEMBL769282 0.83 EPHX2 (0.32) ALOX5GAAMEN1KMT2AMAOA
SCHEMBL104649 0.83 ALOX5 (0.42) ALOX5GAAMEN1KMT2AMAOA
SCHEMBL207238 0.82 EPHX2 (0.39) GAAKMT2AMAOAMAOBP2RY10
SCHEMBL23533531 0.81 CNR2 (0.41) ALOX5GAAMEN1KMT2AMAOA
SCHEMBL9871733 0.81 CNR2 (0.41) ALOX5GAAMEN1KMT2AMAOA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6515051-B2 Stability and durability and a low loss rate when incorporated into automotive coatings; soluble in a variety of substrates including thermoplastic polymers and often are colorless CIBA SPECIALTY CHEMICALS CORPORATION 2003-02-04 US disclosed
US-6458872-B1 FOR USE IN AUTOMOTIVE COATINGS, THERMOPLASTIC FORMULATIONS CIBA SPECIALTY CHEMICALS CORPORATION 2002-10-01 US disclosed
US-20020099221-A1 Benzotriazole UV absorbers having enhanced durability RAVICHANDRAN RAMANATHAN (US) 2002-07-25 US disclosed
US-20020065341-A1 Benzotriazole UV absorbers having enhanced durability RAVICHANDRAN RAMANATHAN (US) 2002-05-30 US disclosed
US-6262151-B1 FOR AUTOMOTIVE COATINGS CIBA SPECIALTY CHEMICALS CORPORATION 2001-07-17 US disclosed
US-6166218-A Benzotriazole UV absorbers having enhanced durability CIBA SPECIALTY CHEMICALS CORPORATION (US) 2000-12-26 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020099221-A1 Benzotriazole UV absorbers having enhanced durability TERT, AHR, ARNT PDE1A 4869/4885PDE1B 4865/4885PDE1C 4876/4885
US-20020065341-A1 Benzotriazole UV absorbers having enhanced durability TERT, AHR, ARNT PDE1A 4869/4885PDE1B 4865/4885PDE1C 4876/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.